2-[1-adamantylcarbamoyl(2-methylpropyl)amino]-N-[5-methyl-2-(2-methylphenyl)-4-phenyl-pyrazol-3-yl]ethanamide

Systemtic Name: 2-[1-adamantylcarbamoyl(2-methylpropyl)amino]-N-[5-methyl-2-(2-methylphenyl)-4-phenyl-pyrazol-3-yl]ethanamide Openeye Name: 2-[1-adamantylcarbamoyl(isobutyl)amino]-N-[5-methyl-2-(o-tolyl)-4-phenyl-pyrazol-3-yl]acetamide CAS Name: 2-[[(1-adamantylamino)-oxomethyl]-(2-methylpropyl)amino]-N-[5-methyl-2-(2-methylphenyl)-4-phenyl-3-pyrazolyl]acetamide IUPAC Name: 2-[1-adamantylcarbamoyl(2-methylpropyl)amino]-N-[5-methyl-2-(2-methylphenyl)-4-phenylpyrazol-3-yl]acetamide Traditional Name: 2-[1-adamantylcarbamoyl(isobutyl)amino]-N-[5-methyl-2-(o-tolyl)-4-phenyl-pyrazol-3-yl]acetamide Formula: C34H43N5O2 MolecularWeight: 553.73752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=C(C(=N2)C)C3=CC=CC=C3)NC(=O)CN(CC(C)C)C(=O)NC45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CC1=CC=CC=C1N2C(=C(C(=N2)C)C3=CC=CC=C3)NC(=O)CN(CC(C)C)C(=O)NC45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C34H43N5O2/c1-22(2)20-38(33(41)36-34-17-25-14-26(18-34)16-27(15-25)19-34)21-30(40)35-32-31(28-11-6-5-7-12-28)24(4)37-39(32)29-13-9-8-10-23(29)3/h5-13,22,25-27H,14-21H2,1-4H3,(H,35,40)(H,36,41)